COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK173778
Chemical Name: ethyl2-{[(2E)-3-(4-chloro-3-nitrophenyl)prop-2-enoyl]amino}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)NC(=O)/C=C/c1ccc(c(c1)[N+](=O)[O-])Cl

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Molecular Weight: 395.82
Empirical Formula: C16H14ClN3O5S

Physical State: Dry powder
Available Amount: 330 mg

Lipinsky:
logP: 4.11
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 142
Number of rings: 2

     

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